SCHEMBL7138309

SCHEMBL7138309

Cc1ccc(C=C2C(=O)Nc3ccc(Br)c(C)c32)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ RET P07949 6/20 0.41
▸ PDGFRB P09619 1/20 0.41
▸ FLT3 P36888 3/20 0.40
▸ MDM2 Q00987 1/20 0.40
▸ PDPK1 O15530 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ GSK3B P49841 1/20 0.37
▸ KDR P35968 1/20 0.37
▸ CCNB2 O95067 1/20 0.37
▸ CDK1 P06493 1/20 0.37
▸ CCNB1 P14635 1/20 0.37
▸ CCNB3 Q8WWL7 1/20 0.37
▸ BCHE P06276 1/20 0.35
▸ CES1 P23141 1/20 0.35
▸ ROS1 P08922 1/20 0.35
▸ CDK5 Q00535 1/20 0.35
▸ ACVR1 Q04771 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7139244 0.90 MEN1 (0.51) MEN1KMT2ARETPDGFRBFLT3
SCHEMBL7132935 0.84 MEN1 (0.56) MEN1KMT2ARETPDGFRBFLT3
SCHEMBL7134045 0.82 KMT2A (0.42) MEN1KMT2ARETPDGFRBFLT3
SCHEMBL7134014 0.81 RET (0.48) MEN1KMT2ARETPDGFRBMDM2
SCHEMBL7140872 0.80 MDM2 (0.51) RETMDM2LRRK2
SCHEMBL5369354 0.79 MAP3K7 (0.54) MEN1KMT2ARETFLT3MDM2
SCHEMBL5369742 0.79 MAP3K7 (0.45) MEN1KMT2ARETFLT3MDM2
SCHEMBL5359703 0.79 RET (0.37) MEN1KMT2ARETPDGFRBFLT3
SCHEMBL7138246 0.78 MDM2 (0.42) PDGFRBMDM2PDPK1MAPTKDR
SCHEMBL5362861 0.78 MEN1 (0.46) MEN1KMT2APDGFRBFLT3MDM2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6506763-B2 Useful in prevention and treatment of protein kinase related disorders such as cancer SUGEN, INC. 2003-01-14 — — US disclosed
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